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Chloroxynil

CAT: 0013-GTR19263838-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19263838-01Size:10 mg
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Description
Chloroxynil acts as an activator for Agrobacterium tumefaciens Vir genes, enhancing T-DNA transfer efficiency by stimulating Vir gene expression in Agrobacterium. Chloroxynil holds potential for studying transformation efficiency mediated by rhizobia in legumes and rice.
CAS Number
1891-95-8
Smiles
N#CC1=CC (Cl) =C (O) C (Cl) =C1
Molecular Formula
C7H3Cl2NO
Molecular Weight
188.01
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Chloroxynil
CAS Number1891-95-8
PubChem CID74685
IUPAC Name3,5-dichloro-4-hydroxybenzonitrile
Molecular FormulaC7H3Cl2NO
Molecular Weight188.01
XLogP2.8
Topological Polar Surface Area44
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity176
SMILES
C1=C(C=C(C(=C1Cl)O)Cl)C#N
InChI
InChI=1S/C7H3Cl2NO/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,11H
InChIKey
YRSSHOVRSMQULE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Chloroxynil
CAS: 1891-95-8
CID: 74685
Formula: C7H3Cl2NO
MW: 188.01
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight188.01
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass186.9591691
Monoisotopic Mass186.9591691
Topological Polar Surface Area44 Ų
Heavy Atom Count11
Formal Charge0
Complexity176
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
sc-227643Chloroxynil

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